Geometry & MOs

Info

ID:	123502
PubChem CID:	50850999
Reduced:	ON2F6H12C16 (1)
Stoich.:	AB2C6D12E16 (1)
Weight, g/mol:	179.105862
ΔH_f, kcal/mol:	-284.05
Dipole, Da:	3.31
IP(EA), eV:	-8.7(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-(dimethylamino)benzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C2=CC=CC=C21)C3N(C=CN3C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations